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Ethyl 2-phenyl-2-((4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl)oct-7-enoate
SpectraBase Compound ID DM3Yfm4wlMc
InChI InChI=1S/C23H35BO4/c1-7-9-10-14-17-23(20(25)26-8-2,19-15-12-11-13-16-19)18-24-27-21(3,4)22(5,6)28-24/h7,11-13,15-16H,1,8-10,14,17-18H2,2-6H3
InChIKey MSWGHCMYVFBOEJ-UHFFFAOYSA-N
Mol Weight 386.3 g/mol
Molecular Formula C23H35BO4
Exact Mass 386.26284 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7nnJXJ5jjCT
Name Ethyl 2-phenyl-2-((4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)methyl)oct-7-enoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35BO4
InChI InChI=1S/C23H35BO4/c1-7-9-10-14-17-23(20(25)26-8-2,19-15-12-11-13-16-19)18-24-27-21(3,4)22(5,6)28-24/h7,11-13,15-16H,1,8-10,14,17-18H2,2-6H3
InChIKey MSWGHCMYVFBOEJ-UHFFFAOYSA-N
Instrument Name Agilent 7890A-5975C VL/5975 GC
Ionization Type EI
Literature Reference DOI 10.1021/acs.orglett.1c00617
Molecular Weight 386.339 g/mol
Reported Formula C23H35(10)BO4
SMILES c1cc(C(CCCCC=C)(C(OCC)=O)CB2OC(C(O2)(C)C)(C)C)ccc1
SPLASH splash10-0pc0-3900000000-ffbdde16fda1d070381e
Source of Spectrum A1-23-SM25-2r
Thin-Layer Chromatography Rf = 0.35 (silica, petroleum ether/ethyl acetate, 20:1)
Wiley ID 1868183